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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	8-Nov-2018	/water/complexes aq-fenilomek	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-374.5166749; Eh
	8-Nov-2018	/water/complexes aq-fenilomemno3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-676.1551481; Eh
	9-Nov-2018	/noDisp/complexes sin-ph3niph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-857.2454295; Eh
	8-Nov-2018	/water/complexes aq-fenilomenbnh24	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-627.1189659; Eh
	8-Nov-2018	/water/complexes aq-fenilomemosh3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1610.8652029; Eh
	31-Aug-2016	t1	Kuniyil, Rositha	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB97D	6-31g(d); SDD	-2273.73960323; Eh
	8-Nov-2018	/water/complexes aq-fenilomepdhph32	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1161.0377374; Eh
	8-Nov-2018	/water/complexes aq-fenilomeoso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-662.3646322; Eh
	31-Aug-2016	32-E	Kuniyil, Rositha	Gaussian; 09; EM64L-G09RevA.02	Geometry optimization Minimum	RB97D	6-31G(d)	-980.222157615; Eh
	8-Nov-2018	/water/complexes aq-fenilomeptf5singlete	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-965.1998202; Eh

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